Dataset

ETHYL P-AMINOBENZOATE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP003194 contains the MS mass spectrum of ETHYL P-AMINOBENZOATE with the InChIkey BLFLLBZGZJTVJG-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3
SMILES	CCOC(=O)c(c1)ccc(N)c1
InChI Key	BLFLLBZGZJTVJG-UHFFFAOYSA-N
Molecular Formula	C9H11NO2
Exact Mass	165.079 g/mol

Data and Resources

ETHYL P-AMINOBENZOATEHTML
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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP003194
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T15:56:25.937142
MetadataModified	2025-02-09T11:44:40.569405
MetadataPublished	2016-01-19
Related Molecule

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
164015	Brenda
37093	Brenda
HMDB0004992	Human Metabolome Database
ZINC000012358719	ZINC
CB9339022	ChemicalBook
CB1217951	ChemicalBook
benzocaine	DailyMed
MCULE-6566052626	Mcule
116735	ChEBI
2337	PubChem
15219432	PubChem: Thomson Pharma
PD002459	ProbesDrugs
ETHYL AMINOBENZOATE	clinicaltrials
U3RSY48JW5	FDA SRS
LSM-5830	LINCS
SCHEMBL25100	SureChEMBL
94-09-7	ACToR
71123-91-6	ACToR
PA448576	PharmGKB
1333-08-0	ACToR
476470	eMolecules
DB01086	DrugBank
C07527	KEGG Ligand
CHEMBL278172	ChEMBL
BENZOCAINE	rxnorm
LANACANE	rxnorm
ORAJEL	rxnorm
AMERICAINE	rxnorm
FLAVAMED	clinicaltrials
AR-01	clinicaltrials
AMERICAINE	clinicaltrials
BABY ANBESOL	clinicaltrials
ANAESTHESIN	clinicaltrials
NORCAINE	clinicaltrials
HY-Y0258	MedChemExpress
BENZOCAINE	clinicaltrials
DTXSID8021804	EPA CompTox Dashboard
323	DrugCentral
J4.690F	Nikkaji
QQQAXG	CCDC
233974	Brenda
BENZOCAINE	DailyMed
197282	BindingDB
The data in this table is sourced from UniChem at EBI.